ethyl 3-butyl-6-[3-[2-(4-fluorophenyl)ethanoylamino]phenyl]-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-butyl-6-[3-[2-(4-fluorophenyl)ethanoylamino]phenyl]-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-butyl-6-[3-[[2-(4-fluorophenyl)acetyl]amino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-6-[3-[[2-(4-fluorophenyl)-1-oxoethyl]amino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-butyl-6-[3-[[2-(4-fluorophenyl)acetyl]amino]phenyl]-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-6-[3-[[2-(4-fluorophenyl)acetyl]amino]phenyl]-2-keto-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C31H32FN3O4 MolecularWeight: 529.601883

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)CC3=CC=C(C=C3)F)C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)CC3=CC=C(C=C3)F)C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C31H32FN3O4/c1-3-5-18-35-29(22-10-7-6-8-11-22)27(30(37)39-4-2)28(34-31(35)38)23-12-9-13-25(20-23)33-26(36)19-21-14-16-24(32)17-15-21/h6-17,20,28H,3-5,18-19H2,1-2H3,(H,33,36)(H,34,38)